0 B11R2.106 BrC1=NC=CC2=C1C=CS2 D74403 [0,0,0,0,0,0|4,0,0]=4 1 B11R2.106 BrC1=NC=NC2=C1NC=C2 FD7079 [0,0,0,0,0,0|4,0,0]=4 2 B11R2.106 BrC1=NC=NN2C=CC=C12 55363 [0,0,0,0,0,0|4,0,0]=4 3 B11R2.106 CC1=CC=CC2=C1N=NN2 C80091 [0,0,0,0,0,0|4,0,0]=4 4 B11R2.106 CC1=NC=CC2=C1N=NC2 F17937 [0,0,0,0,0,0|4,0,0]=4 5 B11R2.106 CC1=NC=NC2=C1N=CN2 O11610 [0,0,0,0,0,0|3,0,0]=3 6 B11R2.106 ClC1=C2C=COC2=NC=C1 P12454 [0,0,0,0,0,0|4,0,0]=4 7 B11R2.106 ClC1=NC=NC2=C1COC2 85700 [0,0,0,0,0,0|3,0,1]=4 8 B11R2.106 ClC1=NC=NC2=C1CSC2 69821 [0,0,0,0,0,0|3,0,1]=4 9 B11R2.106 ClC1=NC=NC2=C1NN=C2 AT12419 [0,0,0,0,0,0|3,0,0]=3 10 B11R2.106 Cl[C@H]1C=CNC2=C1C=NN2 F18195 [0,0,0,0,0,0|2,0,2]=4 11 B11R2.106 IC1=C2N=NNC2=CC=C1 O11246 [0,0,0,0,0,0|4,0,0]=4 12 B11R2.106 NC1=CC=CC2=C1C=NO2 D82709 [0,0,0,0,0,0|4,0,0]=4 13 B11R2.106 NC1=NC=CC2=C1NN=C2 F13264 [0,0,0,0,0,0|4,0,0]=4 14 B11R2.106 NC1=NC=NC2=C1CCN2 C16504 [0,0,0,0,0,0|2,0,1]=3 15 B11R2.106 NC1=NC=NC2=C1N=NN2 W18787 [0,0,0,0,0,0|2,0,0]=2 16 B11R2.106 O=C1NC=NC2=C1NN=N2 T70692 [0,0,0,0,0,0|1,0,3]=4 17 B11R2.106 O=C1NC=NN2C=NC=C12 P10557 [0,0,0,0,0,0|2,0,2]=4 18 B11R2.106 OC1=C2C=NNC2=NC=C1 P10699 [0,0,0,0,0,0|1,0,0]=1 19 B11R2.106 OC1=C2OC=CC2=NC=N1 71918 [0,0,0,0,0,0|3,0,0]=3 20 B11R2.106 OC1=NC=CC2=C1C=CN2 F30254 [0,0,0,0,0,0|2,0,0]=2 21 B11R2.106 OC1=NN=CC2=C1C=CO2 91175 [0,0,0,0,0,0|4,0,0]=4 22 B10R2.7 C1=CC2=C(C=CO2)C=N1 D74565 [1,0,0,0,0,0|3,0,0]=4 23 B10R2.7 C1=CC2=C(C=N1)NN=C2 W10136 [1,0,0,0,0,0|3,0,0]=4 24 B10R2.7 C1=CN=C2NCCC2=C1 C13729 [1,0,0,0,0,0|2,0,1]=4 25 B10R2.7 C1=NC=C2CCNC2=N1 93647 [1,0,0,0,0,0|1,0,1]=3 26 B10R2.7 C1=NC=C2CCNC2=N1 C90715 [1,0,0,0,0,0|1,0,1]=3 27 B12R2.82 ClC1=C(Cl)C2=C(C=C1)NN=C2 F18732 [0,1,0,0,0,0|3,0,0]=4 28 B12R2.82 NC1=C(Cl)C2=C(N=C1)NC=C2 C16741 [0,1,0,0,0,0|3,0,0]=4 29 B12R2.196 CN1N=CC2=C(I)C=CN=C21 C91550 [0,1,0,0,0,0|2,0,0]=3 30 B12R2.196 CN1N=CC2=C1N=CN=C2Br P11184 [0,1,0,0,0,0|1,0,0]=2 31 B12R2.196 CN1N=CC2=C1N=CN=C2N BL003935 [0,1,0,0,0,0|1,0,0]=2 32 B12R2.196 CN1N=NC2=C1N=CN=C2Cl 26725 [0,1,0,0,0,0|2,0,0]=3 33 B12R2.196 ClC1=C2NN=C(Br)C2=NC=N1 P10746 [0,1,0,0,0,0|3,0,0]=4 34 B12R2.196 NC1=C2NN=C(I)C2=NC=N1 F18368 [0,1,0,0,0,0|3,0,0]=4 35 B12R2.196 NC1=NC=NC2=C(Br)SC=C12 P13470 [0,1,0,0,0,0|3,0,0]=4 36 B12R2.202 BrC1=CC2=C(N=CN=C2I)S1 57903 [0,1,0,0,0,0|3,0,0]=4 37 B12R2.202 CC1=CC2=C(C=CN=C2Cl)N1 I10786 [0,1,0,0,0,0|3,0,0]=4 38 B12R2.202 CC1=CC2=C(F)C=CN=C2N1 P11167 [0,1,0,0,0,0|3,0,0]=4 39 B12R2.202 CC1=CC2=C(N=CN=C2N)N1 P10669 [0,1,0,0,0,0|2,0,0]=3 40 B12R2.202 ClC1=CC2=C(N=CN=C2Cl)N1 AC8736 [0,1,0,0,0,0|2,0,0]=3 41 B12R2.202 NC1=NC2=C(N=CN=C2N)N1 C15483 [0,1,0,0,0,0|3,0,0]=4 42 B12R2.202 O=C1NC2=C(N1)C(Cl)=NC=N2 C90467 [0,1,0,0,0,0|3,0,0]=4 43 B12R2.203 BrC1=NNC2=CC=CC(I)=C21 C16605 [0,1,0,0,0,0|3,0,0]=4 44 B12R2.203 CC1=C2C(=CC=C1)NN=C2Cl F18554 [0,1,0,0,0,0|3,0,0]=4 45 B12R2.203 CC1=C2C(=CC=C1)NN=C2O F18288 [0,1,0,0,0,0|3,0,0]=4 46 B12R2.203 CC1=C2C(Br)=CNC2=NC=C1 I10822 [0,1,0,0,0,0|3,0,0]=4 47 B12R2.203 CC1=C2C(Cl)=CNC2=NC=C1 57836 [0,1,0,0,0,0|3,0,0]=4 48 B12R2.203 CC1=C2C(N)=NNC2=NC=C1 51575 [0,1,0,0,0,0|2,0,0]=3 49 B12R2.203 CC1=CNC2=NC=CC(N)=C12 P13299 [0,1,0,0,0,0|3,0,0]=4 50 B12R2.203 CC1=COC2=NC=NC(N)=C12 88901 [0,1,0,0,0,0|3,0,0]=4 51 B12R2.203 CC1=CSC2=NC=NC(N)=C12 W10176 [0,1,0,0,0,0|3,0,0]=4 52 B12R2.203 CC1=NNC2=CC=CC(O)=C21 F17559 [0,1,0,0,0,0|2,0,0]=3 53 B12R2.203 CC1=NNC2=NC=CC(Cl)=C12 O11214 [0,1,0,0,0,0|2,0,0]=3 54 B12R2.203 CC1=NSC2=C1C(=O)NC=N2 86912 [0,1,0,0,0,0|1,0,2]=4 55 B12R2.203 ClC1=CNC2=NC=CC(Br)=C12 91272 [0,1,0,0,0,0|3,0,0]=4 56 B12R2.203 IC1=NNC2=CC=CC(I)=C21 C16604 [0,1,0,0,0,0|3,0,0]=4 57 B12R2.203 NC1=CNC2=NC=CC(Br)=C12 91271 [0,1,0,0,0,0|3,0,0]=4 58 B12R2.203 NC1=NNC2=C1C(Br)=NC=C2 90733 [0,1,0,0,0,0|2,0,0]=3 59 B12R2.203 NC1=NNC2=NC=CC(Cl)=C12 F18588 [0,1,0,0,0,0|2,0,0]=3 60 B12R2.203 OC1=C2C(Br)=CSC2=NC=N1 W13342 [0,1,0,0,0,0|2,0,0]=3 61 B12R2.221 CC1=C2NC=CC2=C(O)C=C1 F18320 [0,1,0,0,0,0|3,0,0]=4 62 B12R2.221 CC1=CN=C(Cl)C2=C1NN=C2 F18614 [0,1,0,0,0,0|2,0,0]=3 63 B12R2.221 ClC1=C2C=NNC2=C(Br)C=C1 AT19839 [0,1,0,0,0,0|3,0,0]=4 64 B12R2.221 FC1=C2C=NNC2=C(F)C=C1 I11408 [0,1,0,0,0,0|3,0,0]=4 65 B12R2.221 FC1=C2NN=CC2=C(Cl)C=C1 I11283 [0,1,0,0,0,0|3,0,0]=4 66 B12R2.221 NC1=C2C=NNC2=C(Cl)C=C1 C91477 [0,1,0,0,0,0|3,0,0]=4 67 B12R2.221 OC1=C2C=CNC2=C(Cl)C=C1 W10565 [0,1,0,0,0,0|3,0,0]=4 68 B12R2.221 [O-][N+]1=CN=C(O)C2=C1NC=N2 S11540 [0,1,0,0,0,0|2,0,1]=4 69 B12R2.246 CC1=C2C=CNC2=NC(Cl)=N1 93472 [0,1,0,0,0,0|2,0,0]=3 70 B12R2.246 CC1=CC2=C(C=CN2)C(Br)=N1 88941 [0,1,0,0,0,0|3,0,0]=4 71 B12R2.246 CC1=CC2=C(C=CN2)C(O)=N1 88940 [0,1,0,0,0,0|2,0,0]=3 72 B12R2.246 ClC1=C2N=CNC2=NC(Br)=N1 C90301 [0,1,0,0,0,0|3,0,0]=4 73 B12R2.246 ClC1=C2N=CNC2=NC(I)=N1 F30526 [0,1,0,0,0,0|3,0,0]=4 74 B12R2.246 NC1=C2C=CNC2=NC(S)=N1 51144 [0,1,0,0,0,0|2,0,0]=3 75 B12R2.246 NC1=C2C=NNC2=CC(I)=C1 P10505 [0,1,0,0,0,0|3,0,0]=4 76 B12R2.246 NC1=CC(Br)=C2N=NNC2=N1 C91485 [0,1,0,0,0,0|3,0,0]=4 77 B12R2.246 NC1=NC(=O)C2=C(NN=C2)N1 BL006452 [0,1,0,0,0,0|0,0,2]=3 78 B12R2.246 NC1=NC(N)=C2C=CNC2=N1 D73407 [0,1,0,0,0,0|2,0,0]=3 79 B12R2.246 NC1=NC(O)=C2SC=CC2=N1 57699 [0,1,0,0,0,0|3,0,0]=4 80 B12R2.246 NC1=NC2=C(C=NN2)C(O)=N1 E10288 [0,1,0,0,0,0|0,0,0]=1 81 B12R2.246 O=C1N=C(Cl)NC2=C1C=NN2 AC6129 [0,1,0,0,0,0|0,0,2]=3 82 B12R2.246 OC1=C2C=NOC2=CC(Br)=C1 93711 [0,1,0,0,0,0|3,0,0]=4 83 B12R2.246 OC1=NC(O)=C2OC=CC2=N1 59871 [0,1,0,0,0,0|3,0,0]=4 84 B12R2.246 OC1=NC(O)=C2SC=NC2=N1 O12149 [0,1,0,0,0,0|2,0,1]=4 85 B12R2.246 OC1=NC(O)=C2SCCC2=N1 50638 [0,1,0,0,0,0|3,0,0]=4 86 B12R2.315 CNC1=C2C=NN=C2N=CN1 D73431 [0,1,0,0,0,0|1,0,2]=4 87 B12R2.315 CNC1=CC=CC2=C1C=NN2 P18752 [0,1,0,0,0,0|3,0,0]=4 88 B12R2.315 COC1=C2OC=CC2=NC=N1 57209 [0,1,0,0,0,0|3,0,0]=4 89 B12R2.315 N#CC1=C2C=NNC2=NC=C1 F18447 [0,1,0,0,0,0|2,0,0]=3 90 B12R2.315 NCC1=C2C=NNC2=NC=C1 F17799 [0,1,0,0,0,0|2,0,0]=3 91 B12R2.315 NNC1=C2C=NNC2=NC=C1 F18135 [0,1,0,0,0,0|2,0,0]=3 92 B10R1.2 CCC1=NC=NC(O)=C1Br F13817 [0,0,1,0,0,0|3,0,0]=4 93 B10R1.2 CNC1=NC=NC(Cl)=C1Br N10078 [0,0,1,0,0,0|3,0,0]=4 94 B10R1.2 COC1=NC=NC(O)=C1C C14793 [0,0,1,0,0,0|2,0,1]=4 95 B10R1.2 NNC1=C(N)C(Cl)=NC=N1 C15795 [0,0,1,0,0,0|2,0,1]=4 96 B10R1.245 COC1=C(O)N=CN=C1O F12218 [0,0,1,0,0,0|3,0,0]=4 97 B10R1.245 NC1=C(C=O)C(F)=NC=C1 O11152 [0,0,1,0,0,0|3,0,0]=4 98 B10R2.32 O=C1CCC2=C1C=NN2 D85467 [0,0,0,0,1,0|1,0,2]=4 99 B12R2.1081 ClC1=NC=NC2=C1CCNC2 70943 [0,0,0,0,0,1|2,0,1]=4 100 B12R2.1081 ClC1=NC=NC2=C1CCNC2 AC5242 [0,0,0,0,0,1|2,0,1]=4 101 B12R2.1081 OC1=CC=NC2=C1OCCN2 F52364 [0,0,0,0,0,1|2,0,1]=4 102 B12R2.1081 OC1=CC=NC2=NC=CC=C12 F20689 [0,0,0,0,0,1|2,0,1]=4 103 B12R2.1081 OC1=NC=CC2=CC=CN=C21 54218 [0,0,0,0,0,1|3,0,0]=4 104 B9R1.2 CNC1=CC(Br)=NC=N1 AT18306 [1,0,1,0,0,0|1,0,1]=4 105 B9R1.2 OCC1=CC(O)=NC=N1 59935 [1,0,1,0,0,0|2,0,0]=4 106 B9R1.3 NC1=NC=NC(N)=C1Cl P20502 [1,0,1,0,0,0|2,0,0]=4 107 B9R1.3 OC1=NC=NC(O)=C1Cl S10271 [1,0,1,0,0,0|2,0,0]=4 108 B9R1.15 CC1=C(C=O)C=NC=N1 O11269 [1,0,1,0,0,0|2,0,0]=4 109 B9R1.15 CCC1=CN=CN=C1O C15413 [1,0,1,0,0,0|1,0,1]=4 110 B9R1.15 CNC1=C(F)C=NC=N1 AT18309 [1,0,1,0,0,0|2,0,0]=4 111 B9R1.15 CNC1=C(I)C=NC=N1 AT18314 [1,0,1,0,0,0|2,0,0]=4 112 B9R1.15 NC1=C(C=O)C=NC=C1 W12249 [1,0,1,0,0,0|2,0,0]=4 113 B9R1.15 NC1=C(CO)C=NC=N1 AT18389 [1,0,1,0,0,0|1,0,1]=4 114 B9R1.15 NCC1=C(O)C=CN=C1 AT18117 [1,0,1,0,0,0|1,0,1]=4 115 B9R1.41 O=C(O)C1=C(F)NN=C1 C92334 [1,0,1,0,0,0|2,0,0]=4 116 B11R1.605 O\N=C\C1=C(Cl)N=CN=C1Cl S11119 [0,1,1,0,0,0|2,0,0]=4 117 B11R2.1 CC1=CNC2=NC=NC=C12 P14369 [1,1,0,0,0,0|1,0,0]=3 118 B11R2.1 CN1C=CC2=C1C=CN=C2 D70942 [1,1,0,0,0,0|2,0,0]=4 119 B11R2.1 ClC1=CNC2=C1C=NC=C2 I11117 [1,1,0,0,0,0|2,0,0]=4 120 B11R2.1 ClC1=NSC2=C1C=CC=N2 F30332 [1,1,0,0,0,0|2,0,0]=4 121 B11R2.1 NC1=CNC2=NC=CC=C12 C15185 [1,1,0,0,0,0|2,0,0]=4 122 B11R2.1 OC1=NSC2=NC=CC=C12 F30331 [1,1,0,0,0,0|2,0,0]=4 123 B11R2.1 ON1N=CC2=C1C=CC=C2 E70293 [1,1,0,0,0,0|2,0,0]=4 124 B11R2.36 CC1=NC2=C(C=NN2)C=N1 C11504 [1,1,0,0,0,0|0,0,0]=2 125 B11R2.36 IC1=CN=C2NN=CC2=C1 AT18494 [1,1,0,0,0,0|1,0,0]=3 126 B11R2.36 IC1=NC2=C(C=CN2)C=C1 68997 [1,1,0,0,0,0|2,0,0]=4 127 B11R2.36 NC1=NC2=C(C=CN2)C=C1 30500 [1,1,0,0,0,0|2,0,0]=4 128 B11R2.36 O=C1N=CC2=C(NC=C2)N1 D73411 [1,1,0,0,0,0|1,0,1]=4 129 B11R2.36 SC1=CC2=C(C=C1)NN=C2 F18088 [1,1,0,0,0,0|2,0,0]=4 130 B13R2.32 OC1=C(Cl)C=NC2=CC=NC=C21 C92696 [0,1,0,0,0,1|2,0,0]=4 131 B13R2.162 NC1=NC=NC2=C1NC(=O)CN2 D72900 [0,1,0,0,0,1|2,0,0]=4 132 B13R2.162 OC1=C2N=C(Cl)C=CC2=NC=N1 F30758 [0,1,0,0,0,1|2,0,0]=4 133 B13R2.328 OC1=NC(O)=C2CCCNC2=N1 72549 [0,1,0,0,0,1|1,0,1]=4 134 B13R2.328 OC1=NC2=CN=CC=C2C(O)=N1 51449 [0,1,0,0,0,1|1,0,0]=3 135 B13R2.4818 OC1=C2C(Br)=CC=CC2=NC=N1 83122 [0,1,0,0,0,1|2,0,0]=4 136 B13R2.5179 OC1=C2C=CC(Cl)=NC2=NC=N1 F30746 [0,1,0,0,0,1|1,0,1]=4 137 B13R2.5179 OC1=C2C=CC(F)=CC2=NC=N1 AC3204 [0,1,0,0,0,1|2,0,0]=4 138 B13R2.5179 OC1=C2N=CC(Br)=CC2=NC=N1 FD7029 [0,1,0,0,0,1|2,0,0]=4 139 B13R2.121 COC1=C(Br)C=NC2=C1C=CN2 P11659 [0,2,0,0,0,0|2,0,0]=4 140 B13R2.9 CCN1N=CC2=C1N=CN=C2Cl 84245 [0,2,0,0,0,0|1,0,0]=3 141 B13R2.573 CN1N=CC2=C1N=CN=C2NN D73424 [0,2,0,0,0,0|1,0,0]=3 142 B13R2.3742 CC1=NC2=C(C=NN2C)C(=O)N1 95089 [0,2,0,0,0,0|0,0,2]=4 143 B13R2.3742 CN1N=CC2=C1NC(=O)C=C2O 89630 [0,2,0,0,0,0|1,0,1]=4 144 B13R2.4857 CC1=NN(C)C2=C1C(=O)NC=N2 95093 [0,2,0,0,0,0|0,0,2]=4 145 B13R2.4857 CN1N=C(Br)C2=C1N=CNC2=O D86115 [0,2,0,0,0,0|0,0,2]=4 146 B13R2.4857 CN1N=C(I)C2=C(Cl)N=CN=C21 97711 [0,2,0,0,0,0|1,0,0]=3 147 B13R2.4857 CN1N=C(I)C2=C(O)N=CN=C21 97710 [0,2,0,0,0,0|0,0,0]=2 148 B13R2.54 CCC1=CC2=C(O)N=CN=C2S1 82357 [0,2,0,0,0,0|2,0,0]=4 149 B13R2.581 CC1=CC2=C(N=CN=C2CN)N1 P14446 [0,2,0,0,0,0|2,0,0]=4 150 B13R2.581 COC1=NC=CC2=C1C=C(C)N2 I10754 [0,2,0,0,0,0|2,0,0]=4 151 B13R2.4856 CC1=C(C)C2=C(N=CN=C2N)N1 P10152 [0,2,0,0,0,0|2,0,0]=4 152 B13R2.5397 CC1=CC2=C(N=C(C)N=C2Cl)N1 P16586 [0,2,0,0,0,0|2,0,0]=4 153 B13R2.5397 CC1=CC2=C(O)N=C(C)N=C2S1 C90625 [0,2,0,0,0,0|2,0,0]=4 154 B13R2.5397 ClC1=NC2=C(C=C(I)N2)C(Cl)=N1 P14423 [0,2,0,0,0,0|2,0,0]=4 155 B13R2.582 COC1=C2C(=CC=C1)NN=C2I F17790 [0,2,0,0,0,0|2,0,0]=4 156 B13R2.582 COC1=C2C(=CC=C1)NN=C2N 59858 [0,2,0,0,0,0|2,0,0]=4 157 B13R2.2091 CCC1=CNC2=C1C(Cl)=NC=N2 AT23543 [0,2,0,0,0,0|2,0,0]=4 158 B13R2.2091 CCN1N=CC2=C1C(O)=NC=N2 F50559 [0,2,0,0,0,0|2,0,0]=4 159 B13R2.2091 COC1=NNC2=NC=NC(N)=C21 F31288 [0,2,0,0,0,0|1,0,0]=3 160 B13R2.2091 CSC1=CNC2=C1C(Cl)=NC=N2 P12428 [0,2,0,0,0,0|2,0,0]=4 161 B13R2.2091 N#CC1=NNC2=C1C(Cl)=NC=N2 F18740 [0,2,0,0,0,0|1,0,0]=3 162 B13R2.2091 N#CC1=NNC2=NC=CC(Cl)=C12 P15011 [0,2,0,0,0,0|2,0,0]=4 163 B13R2.2091 O=CC1=NNC2=CC=CC(O)=C21 F17883 [0,2,0,0,0,0|2,0,0]=4 164 B13R2.11642 CC1=NC(Cl)=C2C(Br)=NNC2=N1 O10959 [0,2,0,0,0,0|1,0,0]=3 165 B13R2.11642 CC1=NC(N)=C2C(Br)=NNC2=N1 97110 [0,2,0,0,0,0|1,0,0]=3 166 B13R2.11642 CC1=NC(N)=C2C(I)=NNC2=N1 O11021 [0,2,0,0,0,0|1,0,0]=3 167 B13R2.11642 NC1=C2C(I)=CNC2=NC(Cl)=N1 W16370 [0,2,0,0,0,0|2,0,0]=4 168 B13R2.11642 NC1=NC(Cl)=C2C(Br)=CNC2=N1 AB10339 [0,2,0,0,0,0|2,0,0]=4 169 B13R2.623 COC1=C2C=CNC2=CC(Br)=N1 I10791 [0,2,0,0,0,0|2,0,0]=4 170 B13R2.623 COC1=C2C=CNC2=NC(N)=C1 I10841 [0,2,0,0,0,0|2,0,0]=4 171 B13R2.623 COC1=C2C=NNC2=CC(C)=C1 I11262 [0,2,0,0,0,0|2,0,0]=4 172 B13R2.5569 O=C(O)C1=NC=NC2=C1N=CN2 87276 [0,2,0,0,0,0|2,0,0]=4